[(2R)-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] (3R)-3-phenylbutanoate

Systemtic Name: [(2R)-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] (3R)-3-phenylbutanoate Openeye Name: [(1R)-1-methyl-2-(4-morpholinoanilino)-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [(2R)-1-[4-(4-morpholinyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [(1R)-2-keto-1-methyl-2-(4-morpholinoanilino)ethyl] ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)C(=O)NC1=CC=C(C=C1)N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC(=O)O[C@H](C)C(=O)NC1=CC=C(C=C1)N2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4/c1-17(19-6-4-3-5-7-19)16-22(26)29-18(2)23(27)24-20-8-10-21(11-9-20)25-12-14-28-15-13-25/h3-11,17-18H,12-16H2,1-2H3,(H,24,27)/t17-,18-/m1/s1